1-[2-[(3-aminocarbonylthiophen-2-yl)amino]-2-oxidanylidene-ethyl]piperidine-4-carboxylic acid

Systemtic Name: 1-[2-[(3-aminocarbonylthiophen-2-yl)amino]-2-oxidanylidene-ethyl]piperidine-4-carboxylic acid Openeye Name: 1-[2-[(3-carbamoyl-2-thienyl)amino]-2-oxo-ethyl]piperidine-4-carboxylic acid CAS Name: 1-[2-[(3-carbamoyl-2-thiophenyl)amino]-2-oxoethyl]-4-piperidinecarboxylic acid IUPAC Name: 1-[2-[(3-carbamoylthiophen-2-yl)amino]-2-oxoethyl]piperidine-4-carboxylic acid Traditional Name: 1-[2-[(3-carbamoyl-2-thienyl)amino]-2-keto-ethyl]isonipecotic acid Formula: C13H17N3O4S MolecularWeight: 311.35678

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)O)CC(=O)NC2=C(C=CS2)C(=O)N

Isomeric SMILES

C1CN(CCC1C(=O)O)CC(=O)NC2=C(C=CS2)C(=O)N

InChI

InChI=1S/C13H17N3O4S/c14-11(18)9-3-6-21-12(9)15-10(17)7-16-4-1-8(2-5-16)13(19)20/h3,6,8H,1-2,4-5,7H2,(H2,14,18)(H,15,17)(H,19,20)